methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate

C14H24N2O3 — CID 62028472

IUPACmethyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate
SMILESCOC(=O)CC1CCCCN1CC(=O)N1CCCC1
InChIInChI=1S/C14H24N2O3/c1-19-14(18)10-12-6-2-3-9-16(12)11-13(17)15-7-4-5-8-15/h12H,2-11H2,1H3
InChIKeyVUIVGXUKBSIIMI-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.03
Rot. Bonds4

About methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate

methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate (PubChem CID 62028472) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate
PubChem CID62028472
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Namemethyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate
SMILESCOC(=O)CC1CCCCN1CC(=O)N1CCCC1
InChIInChI=1S/C14H24N2O3/c1-19-14(18)10-12-6-2-3-9-16(12)11-13(17)15-7-4-5-8-15/h12H,2-11H2,1H3
InChIKeyVUIVGXUKBSIIMI-UHFFFAOYSA-N
XLogP1.03
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate?
The IUPAC name of methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate (CID 62028472) is methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate.
What is the SMILES notation for methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate?
The canonical SMILES for methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate is COC(=O)CC1CCCCN1CC(=O)N1CCCC1.
What is the InChIKey of methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate?
The InChIKey is VUIVGXUKBSIIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-19-14(18)10-12-6-2-3-9-16(12)11-13(17)15-7-4-5-8-15/h12H,2-11H2,1H3.
What are the key properties of methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate?
methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate has a molecular weight of 268.36 g/mol, XLogP of 1.03, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-2-yl]acetate is sourced from PubChem (CID 62028472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).